{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5351604 -6.1598104 -8.4073301 ] [ -0.2363098 -0.4243786 -0.5546332 ] [ -2.9229904 -0.0643593 5.012919 ] [ -2.4949735 -4.0760235 -6.31546 ] [ 5.153265 3.9489251 6.7523172 ] [ -0.0785589 0.2035655 -0.9360747 ] [ 7.1147281 6.5720812 4.4482618 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.047048120605797e-08 -9.869104211440694e-09 -1.347002772956813e-08 ] [ -3.786100368259238e-10 -6.799294712878349e-10 -8.886203461594907e-10 ] [ -4.683146881702841e-09 -1.031149657910534e-10 8.031581623764116e-09 ] [ -3.997388211215549e-09 -6.530509557531389e-09 -1.011848236159757e-08 ] [ 8.256440703786913e-09 6.326875472510302e-09 1.081840475406572e-08 ] [ -1.258652329357651e-10 3.261478849014624e-10 -1.499756999662374e-09 ] [ 1.13990510251688e-08 1.052963484863921e-08 7.126901059157725e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.245517 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.961948104700895e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7813233 3.0494924 1.4802913 ] [ 2.309389 0.77481 2.3727675 ] [ 2.7584155 2.8348772 3.8564348 ] [ 4.5412961 0.1270367 2.8184178 ] [ 5.2202709 2.0781635 3.9724149 ] [ 3.4978751 4.6217818 1.054891 ] [ 4.6922239 4.3528502 3.0799415 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7813233e-10 3.0494924e-10 1.4802913e-10 ] [ 2.309389e-10 7.748100000000001e-11 2.3727675e-10 ] [ 2.7584155e-10 2.8348772e-10 3.8564348e-10 ] [ 4.5412961e-10 1.270367e-11 2.818417800000001e-10 ] [ 5.220270900000001e-10 2.0781635e-10 3.9724149e-10 ] [ 3.4978751e-10 4.6217818e-10 1.054891e-10 ] [ 4.692223900000001e-10 4.3528502e-10 3.0799415e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.54e-05 -2.42e-05 4.25e-05 ] [ 3.1e-06 -1.85e-05 -7.1e-06 ] [ 7.1e-06 -3.9e-05 1.71e-05 ] [ -3.55e-05 2.9e-05 1.9e-06 ] [ -2.01e-05 1.31e-05 1.5e-06 ] [ 1.95e-05 5.02e-05 -3.19e-05 ] [ -9.5e-06 -1.06e-05 -2.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.671705237632e-14 -3.877267422336e-14 6.8092506384e-14 ] [ 4.96674752448e-15 -2.96402674848e-14 -1.137545400768e-14 ] [ 1.137545400768e-14 -6.248488821120001e-14 2.739722021568e-14 ] [ -5.68772700384e-14 4.64631220032e-14 3.04413557952e-15 ] [ -3.220375007808e-14 2.098851373248e-14 2.4032649312e-15 ] [ 3.12424441056e-14 8.042926636416e-14 -5.110943420352001e-14 ] [ -1.52206778976e-14 -1.698307218048e-14 -3.84522388992e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.921662 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.871366786227977e-18 } }